SCHEMBL19494844

SCHEMBL19494844

CC[N+](CC)=c1ccc2c(-c3ccccc3C(=O)O)c3cc(OC)ccc3oc-2c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AR P10275 1/20 0.46
▸ FTO Q9C0B1 2/20 0.45
▸ KDM4E B2RXH2 8/20 0.43
▸ POLB P06746 3/20 0.43
▸ ALDH1A1 P00352 6/20 0.42
▸ KMT2A Q03164 5/20 0.42
▸ MEN1 O00255 4/20 0.42
▸ GAA P10253 1/20 0.42
▸ ABCB1 P08183 2/20 0.41
▸ ABCG2 Q9UNQ0 1/20 0.41
▸ HPGD P15428 5/20 0.41
▸ MAPT P10636 4/20 0.41
▸ USP2 O75604 3/20 0.41
▸ THRB P10828 2/20 0.41
▸ HTT P42858 2/20 0.41
▸ RECQL P46063 2/20 0.41
▸ BLM P54132 2/20 0.41
▸ TDP1 Q9NUW8 2/20 0.41
▸ CYP3A4 P08684 2/20 0.41
▸ ALOX15 P16050 1/20 0.41

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL19494880 0.92 ABCB1 (0.45) ARFTOKDM4EPOLBALDH1A1
SCHEMBL19655005 0.91 FTO (0.44) ARFTOKDM4EPOLBALDH1A1
SCHEMBL18854256 0.86 FTO (0.51) FTOKDM4EPOLBALDH1A1KMT2A
SCHEMBL19655002 0.86 FTO (0.46) FTOKDM4EPOLBKMT2AMEN1
SCHEMBL19494744 0.85 SOS1 (0.44) KDM4EPOLBALDH1A1KMT2AMEN1
SCHEMBL19495091 0.85 FTO (0.45) FTOKDM4EPOLBALDH1A1KMT2A
SCHEMBL19655011 0.84 AR (0.39) ARKDM4EPOLBALDH1A1KMT2A
SCHEMBL19495096 0.84 MEN1 (0.52) FTOKDM4EPOLBALDH1A1KMT2A
SCHEMBL19495008 0.84 ABCB1 (0.42) FTOKDM4EPOLBALDH1A1KMT2A
SCHEMBL19655003 0.83 FTO (0.43) FTOKDM4EPOLBALDH1A1KMT2A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170342031-A1 QUENCHER WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) 2017-11-30 — — US disclosed
US-20170342031-A1 QUENCHER WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) 2017-11-30 — — US disclosed
EP-3235876-A1 QUENCHER Wako Pure Chemical Industries, Ltd. (JP) 2017-10-25 — — EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20170342031-A1 QUENCHER AHR, GFER, AKR1A1 AR 4/4885FTO 330/4885KDM4E 3254/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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